7-(cyclohexylmethyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione

Systemtic Name: 7-(cyclohexylmethyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione Openeye Name: 7-(cyclohexylmethyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione CAS Name: 7-(cyclohexylmethyl)-1,3-dimethyl-8-(1-piperazinyl)purine-2,6-dione IUPAC Name: 7-(cyclohexylmethyl)-1,3-dimethyl-8-piperazin-1-ylpurine-2,6-dione Traditional Name: 7-(cyclohexylmethyl)-1,3-dimethyl-8-piperazino-xanthine Formula: C18H28N6O2 MolecularWeight: 360.45392

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCNCC3)CC4CCCCC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCNCC3)CC4CCCCC4

InChI

InChI=1S/C18H28N6O2/c1-21-15-14(16(25)22(2)18(21)26)24(12-13-6-4-3-5-7-13)17(20-15)23-10-8-19-9-11-23/h13,19H,3-12H2,1-2H3